methyl 7-[3-[(4-methylphenyl)sulfonylamino]propanoylamino]heptanoate

Systemtic Name: methyl 7-[3-[(4-methylphenyl)sulfonylamino]propanoylamino]heptanoate Openeye Name: methyl 7-[3-(p-tolylsulfonylamino)propanoylamino]heptanoate CAS Name: 7-[[3-[(4-methylphenyl)sulfonylamino]-1-oxopropyl]amino]heptanoic acid methyl ester IUPAC Name: methyl 7-[3-[(4-methylphenyl)sulfonylamino]propanoylamino]heptanoate Traditional Name: 7-[3-(tosylamino)propanoylamino]enanthic acid methyl ester Formula: C18H28N2O5S MolecularWeight: 384.49032

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NCCC(=O)NCCCCCCC(=O)OC

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NCCC(=O)NCCCCCCC(=O)OC

InChI

InChI=1S/C18H28N2O5S/c1-15-8-10-16(11-9-15)26(23,24)20-14-12-17(21)19-13-6-4-3-5-7-18(22)25-2/h8-11,20H,3-7,12-14H2,1-2H3,(H,19,21)